Deep Learning Insights into Lanthanides Complexation Chemistry

by Artem A. Mitrofanov, Petr I. Matveev, Kristina V. Yakubova, Alexandru Korotcov, Boris Sattarov, Valery Tkachenko, Stepan N. Kalmykov
Published 2021-05-01

Open-source QSAR models for pKa prediction using multiple machine learning approaches

by Kamel Mansouri, Neal F. Cariello, Alexandru Korotcov, Valery Tkachenko, Chris M. Grulke, Catherine S. Sprankle, David Allen, Warren M. Casey, Nicole C. Kleinstreuer, Antony J. Williams
Published 2019-09-01